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Essay, 2 pages (350 words)

Apalutamide c21h15f4n5o2s structure

Contents

  • Bio Activity:
Molecular Formula C 21 H 15 F 4 N 5 O 2 S
Average mass 477. 435 Da
Density 1. 6±0. 1 g/cm 3
Boiling Point
Flash Point
Molar Refractivity 110. 7±0. 4 cm 3
Polarizability 43. 9±0. 5 10 -24 cm 3
Surface Tension 75. 2±5. 0 dyne/cm
Molar Volume 300. 2±5. 0 cm 3
  • Experimental data
  • Predicted – ACD/Labs
  • Predicted – ChemAxon
  • Experimental Physico-chemical Properties
    • Experimental Solubility:

      DMSO 15 mg/mL Ethanol 5 mg/mLMedChem ExpressHY-16060
      Soluble in DMSOAxon Medchem1979
  • Miscellaneous
    • Safety:

      5Axon Medchem1979
      H303; H313; H317; H333; H334; H335; H373Axon Medchem1979
      no pictogramAxon Medchem1979
      P101; P102; P103; P260; P262; P263; P264; P270; P280; P304; P312; P340Axon Medchem1979
      WarningAxon Medchem1979
    • Target Organs:

      Androgen Receptor inhibitorTargetMolT2339
    • Bio Activity:

      Androgen ReceptorMedChem ExpressHY-16060
      Androgen Receptor; GABAA receptorTargetMolT2339
      ARN-509 is a selective and competitive androgen receptor inhibitor with IC50 of 16 nM, useful for prostate cancer treatment. MedChem Express
      ARN-509 is a selective and competitive androgen receptor inhibitor with IC50 of 16 nM, useful for prostate cancer treatment.; IC50 value: 16 nM; Target: androgen receptorARN-509 is an androgen receptor antagonist with potential antineoplastic activity. ARN-509 binds to AR in target tissues thereby preventing androgen-induced receptor activation and facilitating the formation of inactive complexes that cannot be translocated to the nucleus. This prevents binding to and transcription of AR-responsive genes. This ultimately inhibits the expression of genes that regulate prostate cancer cell proliferation and may lead to an inhibition of cell growth in AR-expressing tumor cells. MedChem ExpressHY-16060
      Endocrinology/ HormonesTargetMolT2339

Predicted data is generated using the ACD/Labs Percepta Platform – PhysChem Module

Density: 1. 6±0. 1 g/cm 3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1. 659
Molar Refractivity: 110. 7±0. 4 cm 3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1. 30
ACD/LogD (pH 5. 5): 1. 38
ACD/BCF (pH 5. 5): 6. 54
ACD/KOC (pH 5. 5): 133. 48
ACD/LogD (pH 7. 4): 1. 38
ACD/BCF (pH 7. 4): 6. 54
ACD/KOC (pH 7. 4): 133. 48
Polar Surface Area: 121 Å 2
Polarizability: 43. 9±0. 5 10 -24 cm 3
Surface Tension: 75. 2±5. 0 dyne/cm
Molar Volume: 300. 2±5. 0 cm 3

Click to predict properties on the Chemicalize site

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